4-[3-[4-(5-chloranylthiophen-2-yl)-1-imidazol-1-yl-butan-2-yl]sulfanylpropyl]aniline

Systemtic Name: 4-[3-[4-(5-chloranylthiophen-2-yl)-1-imidazol-1-yl-butan-2-yl]sulfanylpropyl]aniline Openeye Name: 4-[3-[3-(5-chloro-2-thienyl)-1-(imidazol-1-ylmethyl)propyl]sulfanylpropyl]aniline CAS Name: 4-[3-[[4-(5-chloro-2-thiophenyl)-1-(1-imidazolyl)butan-2-yl]thio]propyl]aniline IUPAC Name: 4-[3-[4-(5-chlorothiophen-2-yl)-1-imidazol-1-ylbutan-2-yl]sulfanylpropyl]aniline Traditional Name: [4-[3-[[3-(5-chloro-2-thienyl)-1-(imidazol-1-ylmethyl)propyl]thio]propyl]phenyl]amine Formula: C20H24ClN3S2 MolecularWeight: 406.00766

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCCSC(CCC2=CC=C(S2)Cl)CN3C=CN=C3)N

Isomeric SMILES

C1=CC(=CC=C1CCCSC(CCC2=CC=C(S2)Cl)CN3C=CN=C3)N

InChI

InChI=1S/C20H24ClN3S2/c21-20-10-9-18(26-20)7-8-19(14-24-12-11-23-15-24)25-13-1-2-16-3-5-17(22)6-4-16/h3-6,9-12,15,19H,1-2,7-8,13-14,22H2